SCHEMBL28829409

SCHEMBL28829409

CC(C)Oc1ccc(CNc2ccc(O)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.62
KMT2A Q03164 5/20 0.62
GAA P10253 5/20 0.62
MAPT P10636 5/20 0.62
BLM P54132 3/20 0.62
ALDH1A1 P00352 3/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
POLB P06746 3/20 0.62
HPGD P15428 2/20 0.62
ALOX15 P16050 2/20 0.62
MAPK1 P28482 2/20 0.62
CASP1 P29466 2/20 0.62
HSD17B10 Q99714 2/20 0.62
KDM4E B2RXH2 1/20 0.62
HSP90AA1 P07900 1/20 0.62
HSP90AB1 P08238 1/20 0.62
THRB P10828 1/20 0.62
PLEC Q15149 1/20 0.62
APAF1 O14727 1/20 0.62
USP2 O75604 1/20 0.62

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11786151 0.85 GAA (0.53) MEN1KMT2AGAAMAPTBLM
SCHEMBL4180805 0.83 GAA (0.54) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL19223057 0.83 PPARG (0.60) MEN1KMT2AGAAMAPTBLM
SCHEMBL28846873 0.83 MAPT (0.70) MEN1KMT2AGAAMAPTBLM
SCHEMBL5863587 0.83 MAPT (0.70) MEN1KMT2AGAAMAPTBLM
SCHEMBL6795311 0.82 MAPT (0.80) MEN1KMT2AGAAMAPTBLM
SCHEMBL10055010 0.82 MAPT (0.80) MEN1KMT2AGAAMAPTBLM
SCHEMBL5197463 0.80 ESR1 (0.56) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL28485 0.80 KMT2A (0.56) MEN1KMT2AGAAALDH1A1POLB
SCHEMBL6555845 0.79 GAA (0.66) MEN1KMT2AGAAMAPTBLM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111936559-B Hyperbranched polyesters and their use as wax inhibitors, as pour point depressants, as lubricants or in lubricating oils 巴斯夫欧洲公司 2022-08-30 CN disclosed